Vitas-M small molecule compound

benzyl 4-[2-(benzyloxy)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate

Catalog ID
STK372435
SMILES O=C(C1=C(C)NC2=C(C1c1ccccc1OCc1ccccc1)C(=O)CCC2)OCc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C31H29NO4 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H29NO4/c1-21-28(31(34)36-20-23-13-6-3-7-14-23)29(30-25(32-21)16-10-17-26(30)33)24-15-8-9-18-27(24)35-19-22-11-4-2-5-12-22/h2-9,11-15,18,29,32H,10,16-17,19-20H2,1H3
InChIKey
IFNMNCBKRJPSOZ-UHFFFAOYSA-N
Synonyms

benzyl2methyl5oxo4(2phenylmethoxyphenyl)4678tetrahydro1Hquinoline3carboxylate
benzyl4(2(benzyloxy)phenyl)2methyl5oxo145678hexahydroquinoline3carboxylate
CC1=C(C(C2=C(N1)CCCC2=O)C3=CC=CC=C3OCC4=CC=CC=C4)C(=O)OCC5=CC=CC=C5
InChI=1SC31H29NO4c12128(31(34)362023136371423)29(3025(3221)16101726(30)33)2415891827(24)351922114251222h291115182932H1016171920H21H3
MFCD00771215
ZINC000003098480
ZINC000003098481

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Available files

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